input word = C00012465

Metabolite InformationStructural formula
Name (E,E)-2,9,9-Trimethyl-6-methylene-2,7-cycloundecadien-1-one
gamma-Humulen-9-one
Formula C15H22O
Mw 218.16706532
CAS RN 85526-80-3
C_ID C00012465 ,
InChIKey STWOXFRHRGEHEV-UAJDOLBESA-N
InChICode InChI=1S/C15H22O/c1-12-6-5-7-13(2)14(16)9-11-15(3,4)10-8-12/h7-8,10H,1,5-6,9,11H2,2-4H3/b10-8+,13-7+
SMILES C1(=O)CCC(/C=C/C(=C)CC/C=C/1\C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCineraria fruticulorum Ref.
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OrganismCineraria fruticulorum
ReferenceBohlmann,Phytochem.,21,(1982),2531